Vitas-M small molecule compound
(4E)-5-(3-bromophenyl)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK581099
SMILES Brc1cccc(c1)C1N(c2nccs2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H15BrN2O5S MW 499.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15BrN2O5S/c23-14-3-1-2-12(10-14)18-17(20(27)21(28)25(18)22-24-6-9-31-22)19(26)13-4-5-15-16(11-13)30-8-7-29-15/h1-6,9-11,18,26H,7-8H2/b19-17+InChIKey
HVYWQCWJQFTVGA-HTXNQAPBSA-NSynonyms
(4E)5(3bromophenyl)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(13thiazol2yl)pyrrolidine23dione
Brc1cccc(c1)C1N(c2nccs2)C(=O)C(=O)C1=C(c1ccc2c(c1)OCCO2)O
C1COC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC=CS4)C5=CC(=CC=C5)Br)O
InChI=1SC22H15BrN2O5Sc231431212(1014)1817(20(27)21(28)25(18)2224693122)19(26)13451516(1113)30872915h169111826H78H2b1917+
MFCD07200437
ZINC000101101567
ZINC000101101570
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